UCSF

ZINC02070844

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 12th, 2004 13 Yes

Popular Name: 2-(4-Bromo-2,6-dimethyl-phenoxy)-ethylamine 2-(4-Bromo-2,6-dimethyl-phenoxy)…

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CAS Numbers: , 499980-87-9

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.36 -1.96 -45.57 3 2 1 36 245.14 3 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )